5-(4-nitrooxybutanoyloxy)-2-oxidanyl-benzoic acid

Systemtic Name: 5-(4-nitrooxybutanoyloxy)-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-(4-nitrooxybutanoyloxy)benzoic acid CAS Name: 2-hydroxy-5-(4-nitrooxy-1-oxobutoxy)benzoic acid IUPAC Name: 2-hydroxy-5-(4-nitrooxybutanoyloxy)benzoic acid Traditional Name: 2-hydroxy-5-(4-nitrooxybutanoyloxy)benzoic acid Formula: C11H11NO8 MolecularWeight: 285.20694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OC(=O)CCCO[N+](=O)[O-])C(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1OC(=O)CCCO[N+](=O)[O-])C(=O)O)O

InChI

InChI=1S/C11H11NO8/c13-9-4-3-7(6-8(9)11(15)16)20-10(14)2-1-5-19-12(17)18/h3-4,6,13H,1-2,5H2,(H,15,16)